Monomers
Ethyl 2-chloroacrylate
Identifiers
IUPAC name
ethyl 2-chloroprop-2-enoate
InchI
InChI=1S/C5H7ClO2/c1-3-8-5(7)4(2)6/h2-3H2,1H3
InchI Key
CVUNPKSKGHPMSY-UHFFFAOYSA-N
SMILES
CCOC(=O)C(=C)Cl
Canonical SMILES
CCOC(=O)C(=C)Cl
Isomeric SMILES
CCOC(=O)C(=C)Cl
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C5H7ClO2
Heavy Atom Count
8
Molecular Weight
134.562
Exact Molecular Weight
134.0135
Valence Electrons
46
Radical Electrons
0
tPSA
26.3
MolLogP
1.302
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
15 14 0 0 0 0 0 0 0 0999 V2000
-2.3987 0.8859 -0.4867 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4020 -0.2026 -0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1195 0.1253 -0.2140 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8823 -0.8384 -0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6256 -1.9202 -0.9581 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2233 -0.5948 0.0949 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5073 0.5471 0.7024 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4261 -1.8353 -0.1505 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-2.8777 1.1077 -1.4839 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9477 1.8167 -0.0559 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2101 0.4923 0.1633 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2920 -0.4864 -1.7784 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7054 -1.1523 -0.1885 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7794 1.3254 0.8636 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5091 0.7298 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 1 0
4 5 2 0
4 6 1 0
6 7 2 3
6 8 1 0
1 9 1 0
1 10 1 0
1 11 1 0
2 12 1 0
2 13 1 0
7 14 1 0
7 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers